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8-BROMO-2-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-METHYL-2,3-DIHYDROOXAZOLO-[3,2-B]-THIENO-[3,4-E]-[1,2,4]-THIADIAZINE-5,5-DIOXIDE

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8-BROMO-2-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-METHYL-2,3-DIHYDROOXAZOLO-[3,2-B]-THIENO-[3,4-E]-[1,2,4]-THIADIAZINE-5,5-DIOXIDE
SpectraBase Compound ID 1BunKyiQ3Vh
InChI InChI=1S/C17H18BrN5O3S2/c18-16-15-13(11-27-16)28(24,25)23-10-12(26-17(23)20-15)9-21-5-7-22(8-6-21)14-3-1-2-4-19-14/h1-4,11-12H,5-10H2
InChIKey QICGCNUPBQMBET-UHFFFAOYSA-N
Mol Weight 484.39 g/mol
Molecular Formula C17H18BrN5O3S2
Exact Mass 483.003445 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9LRItRZec7w
Name 8-BROMO-2-[1-[4-(2-PYRIDYL)-PIPERAZINYL]]-METHYL-2,3-DIHYDROOXAZOLO-[3,2-B]-THIENO-[3,4-E]-[1,2,4]-THIADIAZINE-5,5-DIOXIDE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H18BrN5O3S2
InChI InChI=1S/C17H18BrN5O3S2/c18-16-15-13(11-27-16)28(24,25)23-10-12(26-17(23)20-15)9-21-5-7-22(8-6-21)14-3-1-2-4-19-14/h1-4,11-12H,5-10H2
InChIKey QICGCNUPBQMBET-UHFFFAOYSA-N
Literature Reference Author S.VEGA,M.E.ARRANZ,V.J.ARAN
Literature Reference Citation J.HETCYCL.CHEM.,42,763(2005)
Literature Reference DOI 10.1002/jhet.5570420504
Molecular Weight 484.386 g/mol
Sample ID 61118
Solvent CDCl3